Glycoside

GD138216
Name:
Ternstroside FFormula:
C22H26O12Smiles:
O=C(Cc1ccc(O)c(O)c1)OC1C(OCCc2cc(O)c(O)cc2O)OC(CO)C(O)C1OAglycone:
O=C(O)Cc1ccc(O)c(O)c1.OCCc1cc(O)c(O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 12 | RingCount: | 3 |
HBD: | 8 | FractionCSP3: | 0.41 |
AlogP: | -0.63 | Num_rotatable_bonds: | 8 |
MolWt: | 482.44 | Num_heavy_atoms: | 34 |
TPSA: | 206.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD00758
Formula: C8H8O4
Smiles:
O=C(O)Cc1ccc(O)c(O)c1HBA: | 4 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.12 |
AlogP: | 0.72 | Num_rotatable_bonds: | 2 |
MolWt: | 168.15 | Num_heavy_atoms: | 12 |
TPSA: | 77.76 | NumAromaticRings: | 1 |
AD19341
Formula: C8H10O4
Smiles:
OCCc1cc(O)c(O)cc1OHBA: | 4 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.25 |
AlogP: | 0.34 | Num_rotatable_bonds: | 2 |
MolWt: | 170.16 | Num_heavy_atoms: | 12 |
TPSA: | 80.92 | NumAromaticRings: | 1 |